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acetic acid, [[5-(3-hydroxypropyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-
SpectraBase Compound ID 2n0lNecSrkd
InChI InChI=1S/C13H15N3O3S/c17-8-4-7-11-14-15-13(20-9-12(18)19)16(11)10-5-2-1-3-6-10/h1-3,5-6,17H,4,7-9H2,(H,18,19)
InChIKey YPLZOSIILBZKJI-UHFFFAOYSA-N
Mol Weight 293.34 g/mol
Molecular Formula C13H15N3O3S
Exact Mass 293.083413 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BONuViqgfDg
Name acetic acid, [[5-(3-hydroxypropyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C13H15N3O3S/c17-8-4-7-11-14-15-13(20-9-12(18)19)16(11)10-5-2-1-3-6-10/h1-3,5-6,17H,4,7-9H2,(H,18,19)
InChIKey YPLZOSIILBZKJI-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_CB_8313_1703
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/9215784; Labnumber: LP-2190158
Temperature 297 °C